3-[2-(4-methylphenoxy)acetohydrazido]-N-[3-(trifluoromethyl)phenyl]but-2-enamide

3-[2-(4-methylphenoxy)acetohydrazido]-N-[3-(trifluoromethyl)phenyl]but-2-enamide

Formula: C20H20F3N3O3

SMILES: CC(NNC(=O)COC1=CC=C(C)C=C1)=CC(=O)NC1=CC=CC(=C1)C(F)(F)F

IUPAC: 3-[2-(4-methylphenoxy)acetohydrazido]-N-[3-(trifluoromethyl)phenyl]but-2-enamide

InChI: InChI=1S/C20H20F3N3O3/c1-13-6-8-17(9-7-13)29-12-19(28)26-25-14(2)10-18(27)24-16-5-3-4-15(11-16)20(21,22)23/h3-11,25H,12H2,1-2H3,(H,24,27)(H,26,28)

Composition: C (58.97%), H (4.95%), F (13.99%), N (10.31%), O (11.78%)

Molar Mass: 407.393

Atom Count: 49

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	407.145676005
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	HJHLZEFNOHCEEX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	115.36
Topological Polar Surface Area	79.46
Polarizability	37.81
Ring Count	2
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C20H20F3N3O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00